2-[2-chloranyl-4-(1,2,3,4-tetrahydroquinoxalin-6-ylcarbonylcarbamoylamino)phenoxy]ethanoic acid

Systemtic Name: 2-[2-chloranyl-4-(1,2,3,4-tetrahydroquinoxalin-6-ylcarbonylcarbamoylamino)phenoxy]ethanoic acid Openeye Name: 2-[2-chloro-4-(1,2,3,4-tetrahydroquinoxaline-6-carbonylcarbamoylamino)phenoxy]acetic acid CAS Name: 2-[2-chloro-4-[[oxo-[[oxo(1,2,3,4-tetrahydroquinoxalin-6-yl)methyl]amino]methyl]amino]phenoxy]acetic acid IUPAC Name: 2-[2-chloro-4-(1,2,3,4-tetrahydroquinoxaline-6-carbonylcarbamoylamino)phenoxy]acetic acid Traditional Name: 2-[2-chloro-4-(1,2,3,4-tetrahydroquinoxaline-6-carbonylcarbamoylamino)phenoxy]acetic acid Formula: C18H17ClN4O5 MolecularWeight: 404.80438

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C(N1)C=CC(=C2)C(=O)NC(=O)NC3=CC(=C(C=C3)OCC(=O)O)Cl

Isomeric SMILES

C1CNC2=C(N1)C=CC(=C2)C(=O)NC(=O)NC3=CC(=C(C=C3)OCC(=O)O)Cl

InChI

InChI=1S/C18H17ClN4O5/c19-12-8-11(2-4-15(12)28-9-16(24)25)22-18(27)23-17(26)10-1-3-13-14(7-10)21-6-5-20-13/h1-4,7-8,20-21H,5-6,9H2,(H,24,25)(H2,22,23,26,27)